Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PEPD | P12955 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ULK1 | O75385 | 1/20 | 0.31 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL695644 | 0.89 | KMT2A (0.35) | LMNASMN1; SMN2ALDH1A1KMT2AAADAT | |
| SCHEMBL696236 | 0.88 | ADORA2A (0.35) | PEPDADORA2AADORA1MCHR1SCN9A | |
| SCHEMBL695637 | 0.80 | FKBP1A (0.42) | FKBP1ASCN9ARAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL696423 | 0.79 | MCHR1 (0.42) | ADORA2AADORA1MCHR1FPR2ALDH1A1 | |
| SCHEMBL696511 | 0.77 | KMT2A (0.33) | LMNAKMT2AAADATPOLB | |
| SCHEMBL696519 | 0.69 | FKBP1A (0.40) | FKBP1ASCN9ARAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL694464 | 0.69 | MCHR1 (0.41) | ADORA2AADORA1MCHR1FPR2LMNA | |
| SCHEMBL695772 | 0.69 | ALDH1A1 (0.41) | FKBP1ALMNARAB9AALDH1A1 | |
| SCHEMBL696114 | 0.68 | DRD2 (0.38) | FKBP1AFPR2LMNAALDH1A1KMT2A | |
| SCHEMBL696150 | 0.68 | FKBP1A (0.40) | FKBP1ARAB9ASMN1; SMN2ALDH1A1TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421826-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | disclosed |